(2S)-4-(methylamino)-2-[4-(2-methylpropoxy)phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: (2S)-4-(methylamino)-2-[4-(2-methylpropoxy)phenyl]-4-oxidanylidene-butanoic acid Openeye Name: (2S)-2-(4-isobutoxyphenyl)-4-(methylamino)-4-oxo-butanoic acid CAS Name: (2S)-4-(methylamino)-2-[4-(2-methylpropoxy)phenyl]-4-oxobutanoic acid IUPAC Name: (2S)-4-(methylamino)-2-[4-(2-methylpropoxy)phenyl]-4-oxobutanoic acid Traditional Name: (2S)-2-(4-isobutoxyphenyl)-4-keto-4-(methylamino)butyric acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(CC(=O)NC)C(=O)O

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)[C@H](CC(=O)NC)C(=O)O

InChI

InChI=1S/C15H21NO4/c1-10(2)9-20-12-6-4-11(5-7-12)13(15(18)19)8-14(17)16-3/h4-7,10,13H,8-9H2,1-3H3,(H,16,17)(H,18,19)/t13-/m0/s1